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Substance Name: NSC 246132
RN: 58161-65-2
UNII: 3G365OSY3E
InChIKey: ZVPGKONLVQAMJZ-SGLHZKEVSA-N

Molecular Formula

  • C33-H39-N3-O12.Cl-H

Molecular Weight

  • 706.141
 
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Names and Synonyms

Results Name

  • NSC 246132

Name of Substance

  • 5,12-Naphthacenedione, 8-acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-((N-(N,N-dimethylglycyl)glycyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-, monohydrochloride, (8S-cis)-

Synonyms

  • 8-Acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-((N-(N,N-dimethylglycyl)glycyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-5,12-naphthacenedione monohydrochloride, (8S-cis)-
  • NSC 246132
  • UNII-3G365OSY3E

Systematic Name

  • 5,12-Naphthacenedione, 8-acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-((N-(N,N-dimethylglycyl)glycyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-, monohydrochloride, (8S-cis)-

Registry Numbers

CAS Registry Number

  • 58161-65-2

FDA UNII

  • 3G365OSY3E

System Generated Number

  • 0058161652

Molecular Formulas

Molecular Formula

  • C33-H39-N3-O12.Cl-H

Molecular Formula Fragments

  • C33-H39-N3-O12
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/C33H39N3O12.ClH/c1-14-28(40)18(35-21(38)12-34-22(39)13-36(3)4)9-23(47-14)48-20-11-33(45,15(2)37)10-17-25(20)32(44)27-26(30(17)42)29(41)16-7-6-8-19(46-5)24(16)31(27)43;/h6-8,14,18,20,23,28,40,42,44-45H,9-13H2,1-5H3,(H,34,39)(H,35,38);1H/t14-,18-,20-,23-,28+,33-;/m0./s1

InChIKey

ZVPGKONLVQAMJZ-SGLHZKEVSA-N

Smiles

Cl.COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](NC(=O)CNC(=O)CN(C)C)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)C